(phenylmethyl) N-[(3S)-5-methyl-2-oxidanylidene-3,4-dihydro-1,4-benzodiazepin-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(3S)-5-methyl-2-oxidanylidene-3,4-dihydro-1,4-benzodiazepin-3-yl]carbamate Openeye Name: benzyl N-[(3S)-5-methyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl]carbamate CAS Name: N-[(3S)-5-methyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(3S)-5-methyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl]carbamate Traditional Name: N-[(3S)-2-keto-5-methyl-3,4-dihydro-1,4-benzodiazepin-3-yl]carbamic acid benzyl ester Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=NC(=O)C(N1)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C2C=CC=CC2=NC(=O)[C@@H](N1)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3/c1-12-14-9-5-6-10-15(14)20-17(22)16(19-12)21-18(23)24-11-13-7-3-2-4-8-13/h2-10,16,19H,11H2,1H3,(H,21,23)/t16-/m0/s1